기본 정보
- CAS
134963-32-9- 표준 SMILES
COc1ccc(C(Nc2ncnc3c2ncn3[C@@H]2O[C@H](COC(c3ccccc3)(c3ccccc3)c3ccc(OC)cc3)C[C@H]2N2CCCC2)(c2ccccc2)c2ccccc2)cc1- InChIKey
YGFDRZUCFRUOTP-WHCCNUDUSA-N- 분자식
- C54H52N6O4
- 평균 분자량
- 849 g/mol
- 단동위원소 질량
- 848.40500416
이름 및 식별자
- 우선 이름
- Adenosine, 2',3'-dideoxy-N-((4-methoxyphenyl)diphenylmethyl)-5'-O-((4-methoxyphenyl)diphenylmethyl)-2'-(1-pyrrolidinyl)-
- IUPAC
- 9-[(2R,3R,5S)-5-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-3-pyrrolidin-1-yloxolan-2-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine
이름 및 동의어
134963-32-9Adenosine, 2',3'-dideoxy-N-((4-methoxyphenyl)diphenylmethyl)-5'-O-((4-methoxyphenyl)diphenylmethyl)-2'-(1-pyrrolidinyl)-2'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-2',3'-dideoxyadenosineAdenosine, 2',3'-dideoxy-N-[(4-methoxyphenyl)diphenylmethyl]-5'-O-[(4-methoxyphenyl)diphenylmethyl]-2'-(1-pyrrolidinyl)-DTXSID001591632',3'-Dideoxy-N-[(4-methoxyphenyl)di(phenyl)methyl]-5'-O-[(4-methoxyphenyl)di(phenyl)methyl]-2'-(pyrrolidin-1-yl)adenosine9-[(2R,3R,5S)-5-[[(4-methoxyphenyl)-diphenyl-methoxy]methyl]-3-pyrrolidin-1-yl-tetrahydrofuran-2-yl]-N-[(4-methoxyphenyl)-diphenyl-methyl]purin-6-amineAdenosine, 2',3'-dideoxy-N-[(4-methoxyphenyl)diphenylmethyl]-5'-O-[(4-methoxyphenyl)diphenylmethyl]-2'-(1-pyrrolidinyl)- (9CI)
데이터베이스 식별자
- CAS
134963-32-9- PubChem CID
- 451815
- DTXSID
DTXSID00159163
물성
구조 계산 물성
- XLogP
- 10.3
- 극성 표면적
- 95.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 15
- 무거운 원자 수
- 64
- 형식 전하
- 0
- 복잡도
- 1,360
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